| SpectraBase Spectrum ID |
6AXJ2P0fN6m |
| Name |
5-pyrimidinecarboxylic acid, 2-(ethylthio)-4-hydroxy-, ethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.056863425 u |
| Formula |
C9H12N2O3S |
| InChI |
InChI=1S/C9H12N2O3S/c1-3-14-8(13)6-5-10-9(15-4-2)11-7(6)12/h5H,3-4H2,1-2H3,(H,10,11,12) |
| InChIKey |
OVUWQJVYJRQMSC-UHFFFAOYSA-N |
| Molecular Weight |
228.266 g/mol |
| NMR Offset |
16.2999 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2971 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9248495; Lab Info: *0537897*; Lab Number: *0537897* |
| Temperature |
29.85 °C |
